{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnn" } "basis-atom-coordinates" { "source-value" [ [ 0 0.42814 0.864446 ] [ 0.5 0.07186 0.364446 ] [ 0 0.626863 0.613461 ] [ 0 0.373137 0.386539 ] [ 0.5 0.30507 0.627669 ] [ 0.5 0.92814 0.635554 ] [ 0.5 0.873137 0.113461 ] [ 0.5 0.69493 0.372331 ] [ 0 0.19493 0.127669 ] [ 0 0.80507 0.872331 ] [ 0.5 0.126863 0.886539 ] [ 0 0.57186 0.135554 ] [ 0 0.859962 0.269317 ] [ 0.5 0.616981 0.96235 ] [ 0.5 0.640038 0.769317 ] [ 0 0.116981 0.53765 ] [ 0.5 0.359962 0.230683 ] [ 0 0.883019 0.46235 ] [ 0 0.140038 0.730683 ] [ 0.5 0.383019 0.03765 ] ] } "species" { "source-value" [ "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Y" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.96688652001 "source-unit" "angstrom" } "b" { "source-value" 9.42369356155 "source-unit" "angstrom" } "c" { "source-value" 12.2255492121 "source-unit" "angstrom" } }